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58177-25-6 | 1-METHYL-1H-IMIDAZOLE-4-ETHANOL
CAS No: 58177-25-6 Catalog No: AG01DWIE MDL No:MFCD21336088
Product Description
Catalog Number:
AG01DWIE
Chemical Name:
1-METHYL-1H-IMIDAZOLE-4-ETHANOL
CAS Number:
58177-25-6
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
MDL Number:
MFCD21336088
IUPAC Name:
2-(1-methylimidazol-4-yl)ethanol
InChI:
InChI=1S/C6H10N2O/c1-8-4-6(2-3-9)7-5-8/h4-5,9H,2-3H2,1H3
InChI Key:
HFVTWLTWRVRJLS-UHFFFAOYSA-N
SMILES:
Cn1cc(nc1)CCO
Properties
Complexity:
87.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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